N3-(azepan-1-yl)-N3,N5,N5-trimethyl-1,2,4-dithiazolidin-4-ium-3,5-diamine bromide

Systemtic Name: N3-(azepan-1-yl)-N3,N5,N5-trimethyl-1,2,4-dithiazolidin-4-ium-3,5-diamine bromide Openeye Name: N3-(azepan-1-yl)-N3,N5,N5-trimethyl-1,2,4-dithiazolidin-4-ium-3,5-diamine bromide CAS Name: N3-(1-azepanyl)-N3,N5,N5-trimethyl-1,2,4-dithiazolidin-4-ium-3,5-diamine bromide IUPAC Name: 3-N-(azepan-1-yl)-3-N,5-N,5-N-trimethyl-1,2,4-dithiazolidin-4-ium-3,5-diamine bromide Traditional Name: azepan-1-yl-[5-(dimethylamino)-1,2,4-dithiazolidin-4-ium-3-yl]-methyl-amine bromide Formula: C11H25BrN4S2 MolecularWeight: 357.377

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1[NH2+]C(SS1)N(C)N2CCCCCC2.[Br-]

Isomeric SMILES

CN(C)C1[NH2+]C(SS1)N(C)N2CCCCCC2.[Br-]

InChI

InChI=1S/C11H24N4S2.BrH/c1-13(2)10-12-11(17-16-10)14(3)15-8-6-4-5-7-9-15;/h10-12H,4-9H2,1-3H3;1H